CID 209592

20014-08-8

Structural Information

Molecular Formula
C14H24N2O2
SMILES
CCOC1=CC=C(C=C1)NCC(CNC(C)C)O
InChI
InChI=1S/C14H24N2O2/c1-4-18-14-7-5-12(6-8-14)16-10-13(17)9-15-11(2)3/h5-8,11,13,15-17H,4,9-10H2,1-3H3
InChIKey
DNLXCLGAMGRNRQ-UHFFFAOYSA-N
Compound name
1-(4-ethoxyanilino)-3-(propan-2-ylamino)propan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

252.18378 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 253.191056 162.2
[M+Na]+ 275.172998 165.5
[M-H]- 251.176504 163.7
[M+NH4]+ 270.217603 177.9
[M+K]+ 291.146938 163.5
[M+H-H2O]+ 235.181040 154.9
[M+HCOO]- 297.181981 184.0
[M+CH3COO]- 311.197631 200.7
[M+Na-2H]- 273.158446 164.5
[M]+ 252.18323142 162.4
[M]- 252.18432858 162.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.